General Information of the Compound
| Compound ID |
CP0414462
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| Compound Name |
[4-[2-(2-methylphenyl)ethyl]pyridin-2-yl]urea
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| Structure |
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| Formula |
C15H17N3O
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| Molecular Weight |
255.321
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| Canonical SMILES |
Cc1ccccc1CCc1ccnc(NC(N)=O)c1
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| InChI |
InChI=1S/C15H17N3O/c1-11-4-2-3-5-13(11)7-6-12-8-9-17-14(10-12)18-15(16)19/h2-5,8-10H,6-7H2,1H3,(H3,16,17,18,19)
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| InChIKey |
MOTDSKKJECQMDW-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound